In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: (1R)-1-(5-methyl-2-thienyl)-N-[2-([1,2,4]triazolo[4,5-a]pyridin-3-yl)ethyl]ethanamine (1R)-1-(5-methyl-2-thienyl)-N-[2…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.91 | 8.56 | -12.97 | 1 | 4 | 0 | 42 | 286.404 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 9.87 | -53.41 | 2 | 4 | 1 | 47 | 287.412 | 5 | ↓ |